Cas no 1185319-79-2 (3-Bromo-5-methyl-6-(methyl-d3)-pyridine)
3-Bromo-5-methyl-6-(methyl-d3)-pyridine is a deuterated pyridine derivative featuring a bromo substituent at the 3-position and a methyl group at the 5-position, with a deuterated methyl group (CD?) at the 6-position. This compound is particularly valuable in pharmaceutical and agrochemical research, where isotopic labeling enhances metabolic stability studies and improves the detection sensitivity of active compounds in mass spectrometry. The incorporation of deuterium (D) minimizes metabolic cleavage, extending the half-life of labeled analogs. Its high isotopic purity and well-defined structure make it a reliable intermediate for synthesizing deuterated bioactive molecules, facilitating advanced research in drug discovery and mechanistic studies.
1185319-79-2 structure
Product Name:3-Bromo-5-methyl-6-(methyl-d3)-pyridine
3-Bromo-5-methyl-6-(methyl-d3)-pyridine Chemical and Physical Properties
Names and Identifiers
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- 3-Bromo-5-methyl-6-(methyl-d3)-pyridine
- F92421
- AKOS015944433
- 1185319-79-2
-
- Inchi: 1S/C7H8BrN/c1-5-3-7(8)4-9-6(5)2/h3-4H,1-2H3/i2D3
- InChI Key: PVWAMZCIAHXKJP-BMSJAHLVSA-N
- SMILES: CC1C=C(Br)C=NC=1C([2H])([2H])[2H]
Computed Properties
- Exact Mass: 188.00284g/mol
- Monoisotopic Mass: 188.00284g/mol
- Isotope Atom Count: 3
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 9
- Rotatable Bond Count: 0
- Complexity: 94.9
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.3
- Topological Polar Surface Area: 12.9?2
3-Bromo-5-methyl-6-(methyl-d3)-pyridine Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| Cooke Chemical | M0327935-1mg |
3-Bromo-5-methyl-6-(methyl-d3)-pyridine |
1185319-79-2 | 95% | 1mg |
RMB 544.00 | 2025-02-21 | |
| Cooke Chemical | M0327935-5mg |
3-Bromo-5-methyl-6-(methyl-d3)-pyridine |
1185319-79-2 | 95% | 5mg |
RMB 1857.60 | 2025-02-21 |
3-Bromo-5-methyl-6-(methyl-d3)-pyridine Related Literature
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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Cheng Fang,Jinjian Wu,Zahra Sobhani,Md. Al Amin,Youhong Tang Anal. Methods, 2019,11, 163-170
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Ni-Na Sun,Fengli Qu,Xiaobing Zhang,Shufang Zhang,Jinmao You Analyst, 2015,140, 1827-1831
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